⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16246234 | 0.75 | — | — | |
| SCHEMBL467288 | 0.72 | — | — | |
| SCHEMBL10472607 | 0.72 | CA1 (0.43) | — | |
| SCHEMBL4044234 | 0.72 | — | — | |
| SCHEMBL10685279 | 0.72 | — | — | |
| SCHEMBL51235 | 0.69 | — | — | |
| SCHEMBL31508509 | 0.69 | — | — | |
| SCHEMBL29088734 | 0.69 | — | — | |
| SCHEMBL27673478 | 0.69 | — | — | |
| SCHEMBL29198923 | 0.67 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1871211-A | Improved process for preparing benzhydrylthioacetamide | MALLINCKRODT INC (US) | 2006-11-29 | — | — | CN | disclosed |
| CN-1017898-B | AMIDO-SUBSTITUTED DERIVATIVES, METHOD FOR PREPARATION OF SAME AND PHYTOPATHOGENIC FUNGICIDES CONTAINING SAME | NISSAN CHEMICAL IND LTD (JP) | 1992-08-19 | — | — | CN | disclosed |
| CN-87107603-A | The preparation method of the amide derivatives that replaces and contain the bactericide of this compound | — | 1988-08-10 | — | — | CN | disclosed |